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arXiv:cond-mat/9609203 · Physica B Condensed Matter

Polaronic effects in strongly coupled electron-phonon systems: Exact diagonalization results for the 2D Holstein t-J model

H. Fehske, Gerhard Wellein, B. Bäuml, H. Büttner

Published Feb 1, 1997• 4 citations
arXivHTMLPDF
DOI
10.1016/s0921-4526(96)00665-5

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Polaronic effects in strongly coupled electron-phonon systems: Exact diagonalization results for the 2D Holstein t-J model

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missing to date is an application of the powerful ED technique to the calculation of dynamical properties of the Holstein t--J model (HtJM), including the full quantum nature of phonons. In this contribution, we employ the Lanczos algorithm in combination with a kernel polynomial moment expansion and the Maximum Entropy method [5] to investigate the quasiparticle spectrum of a single hole--polaron in the 2D HtJM on a ten--site square lattice. Moreover, we compute different hole--hole/phonon correlation functions at higher doping level in order to comment on hole--binding effects and charge-densitywave (CDW) formation. The HtJM is described by the Hamiltonian [4] H = H ph + H t\\GammaJ \\Gamma p " p ¯h! X i \\Gamma b y i + b i \\Delta ~ h i<F25.

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On The Stability Of Polaronic Superlattices In Strongly Coupled Electron-Phonon Systems

Gerhard Wellein, Holger Fehske, H. Büttner +1 more

We investigate the interplay of electron–phonon (EP) coupling and strong electronic correlations in the frame of the two–dimensional (2D) Holstein t–J model (HtJM), focusing on polaronic ordering phenomena for the quarter–filled band case. The use of direct Lanczos diagonalization on finite lattices allows us to include the effects of quantum phonon fluctuations in the calculation of spin/charge structure factors and hole–phonon correlation functions. In the adiabatic strong coupling regime we found evidence for “self-localization ” of polaronic carriers in a (π, π) charge-modulated structure, a type of superlattice solidification reminiscent of those observed in the nickel perovskites La2−xSrxNiO4+y. Electron diffraction measurements on the nickel oxide analogue of the layered high–Tc 214 copper oxide compound, La2−xNixCuO4, reveal a (π, π)–superstructure spot at quarter filling, i.e. for x = 0.5, which has been interpreted as sign of a truly 2D polaron ordered phase [1]. To study charge – and spin–ordering phenomena in such systems, exhibiting besides a substantial EP interaction strong Coulomb correlations, let us consider the planar t-J model with an additional on-site Holstein hole-phonon coupling:

•Jan 1, 1997•3 citations
missing to date is an application of the powerful ED technique to the calculation of dynamical properties of the Holstein t--J model (HtJM), including the full quantum nature of phonons. In this contribution, we employ the Lanczos algorithm in combination with a kernel polynomial moment expansion and the Maximum Entropy method [5] to investigate the quasiparticle spectrum of a single hole--polaron in the 2D HtJM on a ten--site square lattice. Moreover, we compute different hole--hole/phonon correlation functions at higher doping level in order to comment on hole--binding effects and charge-densitywave (CDW) formation. The HtJM is described by the Hamiltonian [4] H = H ph + H t\\GammaJ \\Gamma p " p ¯h! X i \\Gamma b y i + b i \\Delta ~ h i<F25.
We investigate the orbital effects of a strong external magnetic field on the ground-state properties of a two-dimensional (2D) Holstein polaron, employing variational approaches based on exact diagonalization. From the ground-state energy and the wave function, we calculate the electron-phonon correlation function, the average phonon number, and the Drude weight and investigate the evolution of a 2D Holstein polaron as a function of the magnetic flux. Although the external magnetic field affects the polaron throughout the parameter regime, we show that the magnetic field has a stronger effect on a loosely bound (spatially extended) polaron. We also find that the magnetic field can be used as a tuning parameter, particularly for a weakly coupled polaron, to reduce the spatial extent of a large polaron.
We investigate the interplay of electron–phonon (EP) coupling and strong electronic correlations in the frame of the two–dimensional (2D) Holstein t–J model (HtJM), focusing on polaronic ordering phenomena for the quarter–filled band case. The use of direct Lanczos diagonalization on finite lattices allows us to include the effects of quantum phonon fluctuations in the calculation of spin/charge structure factors and hole–phonon correlation functions. In the adiabatic strong coupling regime we found evidence for “self-localization ” of polaronic carriers in a (π, π) charge-modulated structure, a type of superlattice solidification reminiscent of those observed in the nickel perovskites La2−xSrxNiO4+y. Electron diffraction measurements on the nickel oxide analogue of the layered high–Tc 214 copper oxide compound, La2−xNixCuO4, reveal a (π, π)–superstructure spot at quarter filling, i.e. for x = 0.5, which has been interpreted as sign of a truly 2D polaron ordered phase [1]. To study charge – and spin–ordering phenomena in such systems, exhibiting besides a substantial EP interaction strong Coulomb correlations, let us consider the planar t-J model with an additional on-site Holstein hole-phonon coupling: